5-methyl ara-C
TL;DR: 5-methyl ara-C (CAS 6829-31-8) is a chemical compound with molecular formula C10H15N3O5 and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
Also Known As: 5-Methylcytidine, 5-Methyl ara-C, 5-Methylarabinosylcytosine, Cytarabine Impurity 2, Cytarabine Impurity I
| Molecular Formula | C10H15N3O5 |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.10117 |
| Heavy Atoms | 18 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 6829-31-8 |
|---|---|
| SMILES | CC1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O |
| InChIKey | ZAYHVCMSTBRABG-JAGXHNFQSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-methyl ara-C (CAS 6829-31-8), with molecular formula C10H15N3O5 and molecular weight 257.10 g/mol. IUPAC: 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one.
Chemical Property Profile of 5-methyl ara-C
Property Insights of 5-methyl ara-C
The XLogP value of -2.0 indicates that 5-methyl ara-C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-methyl ara-C. Following Lipinski's Rule of Five, 5-methyl ara-C has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-methyl ara-C?
The CAS number of 5-methyl ara-C is 6829-31-8.
What is the molecular formula of 5-methyl ara-C?
The molecular formula of 5-methyl ara-C is C10H15N3O5.
What is the molecular weight of 5-methyl ara-C?
The molecular weight of 5-methyl ara-C is 257.10 g/mol.
Where can I buy 5-methyl ara-C?
You can request a quote for 5-methyl ara-C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-methyl ara-C?
Yes, KEHONG BIO provides custom synthesis services for 5-methyl ara-C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.